| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 21st, 2010 | 34 | No |
Popular Name: [(2Z)-2-[(3-bromophenyl)methylene]-6-hydroxy-3-oxo-benzofuran-7-yl]methylBLAHone [(2Z)-2-[(3-bromophenyl)methylen…
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| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 4.24 | 12.5 | -61.38 | 2 | 6 | 1 | 77 | 520.403 | 3 | ↓ |
| Hi High (pH 8-9.5) | 4.24 | 10.93 | -41.76 | 0 | 6 | -1 | 79 | 518.387 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.24 | 13.09 | -34.36 | 1 | 6 | 0 | 80 | 519.395 | 3 | ↓ |
| Mid Mid (pH 6-8) | 4.24 | 10.35 | -19.78 | 1 | 6 | 0 | 76 | 519.395 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
